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LNAPS 4:0/N-9:0
SpectraBase Compound ID 6ak7Y2OCRCf
InChI InChI=1S/C19H36NO10P/c1-3-5-6-7-8-9-11-17(22)20-16(19(24)25)14-30-31(26,27)29-13-15(21)12-28-18(23)10-4-2/h15-16,21H,3-14H2,1-2H3,(H,20,22)(H,24,25)(H,26,27)
InChIKey QMPWNZQMMNHIFQ-UHFFFAOYNA-N
Mol Weight 469.5 g/mol
Molecular Formula C19H36NO10P
Exact Mass 469.207683 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8WQefUcP5iP
Name LNAPS 4:0/N-9:0
Classification Glycerophosphoserines [GP03]
Comments N-acyl-lysophosphatidylserine
Copyright Copyright © 2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 469.207683351 u
Formula C19H36NO10P
InChI InChI=1S/C19H36NO10P/c1-3-5-6-7-8-9-11-17(22)20-16(19(24)25)14-30-31(26,27)29-13-15(21)12-28-18(23)10-4-2/h15-16,21H,3-14H2,1-2H3,(H,20,22)(H,24,25)(H,26,27)
InChIKey QMPWNZQMMNHIFQ-UHFFFAOYNA-N
Ion Polarity N
Literature Reference Tsugawa, H.; Ikeda, K.; Takahashi, M.; Satoh, A.; Mori, Y.; Uchino, H.; Okahashi, N.; Yamada, Y.; Tada, I.; Bonini, P.; Higashi, Y.; Okazaki, Y.; Zhou, Z.; Zhu, Z.-J.; Koelmel, J.; Cajka, T.; Fiehn, O.; Saito, K.; Arita, M.; Arita, M. A Lipidome Atlas in MS-DIAL 4. Nature Biotechnology 2020, 38 (10), 1159–1163.
Literature Reference DOI https://doi.org/10.1038/s41587-020-0531-2
Precursor Ion [M-H]-
SMILES CCCCCCCCC(=O)NC(COP(O)(=O)OCC(O)COC(=O)CCC)C(O)=O
Sample Comments theoretical MS2 created from the information of SCIEX 5600 and 6600 with 45CE +-15CES